N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-12-methyl-tridecanethioamide

Systemtic Name: N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-12-methyl-tridecanethioamide Openeye Name: N-[(4-hydroxy-3-methoxy-phenyl)methyl]-12-methyl-tridecanethioamide CAS Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-12-methyltridecanethioamide IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-12-methyltridecanethioamide Traditional Name: 12-methyl-N-vanillyl-tridecanethioamide Formula: C22H37NO2S MolecularWeight: 379.59968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCC(=S)NCC1=CC(=C(C=C1)O)OC

Isomeric SMILES

CC(C)CCCCCCCCCCC(=S)NCC1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C22H37NO2S/c1-18(2)12-10-8-6-4-5-7-9-11-13-22(26)23-17-19-14-15-20(24)21(16-19)25-3/h14-16,18,24H,4-13,17H2,1-3H3,(H,23,26)